UCSF

ZINC71554357

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2011 30 Yes

Popular Name: ethyl ethyl

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Annotations

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Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.59 9.78 -51.47 2 8 1 86 429.522 6 ↓
Mid Mid (pH 6-8) 2.59 7.37 -14.74 1 8 0 85 428.514 6 ↓
Lo Low (pH 4.5-6) 2.59 10.22 -77.91 3 8 2 88 430.53 6 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.